CID 155894016

6-oxo-5-azaspiro[3.4]octane-2-carboxylic acid

Structural Information

Molecular Formula
C8H11NO3
SMILES
C1CC2(CC(C2)C(=O)O)NC1=O
InChI
InChI=1S/C8H11NO3/c10-6-1-2-8(9-6)3-5(4-8)7(11)12/h5H,1-4H2,(H,9,10)(H,11,12)
InChIKey
CFNNIVQLDNMREA-UHFFFAOYSA-N
Compound name
6-oxo-5-azaspiro[3.4]octane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

169.0739 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.08118 138.8
[M+Na]+ 192.06312 142.1
[M+NH4]+ 187.10772 142.7
[M+K]+ 208.03706 140.5
[M-H]- 168.06662 134.9
[M+Na-2H]- 190.04857 139.4
[M]+ 169.07335 136.6
[M]- 169.07445 136.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe